Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.40 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | PPARA | Q07869 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.36 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.36 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL8095263 | 0.86 | POLB (0.44) | TSHRMEN1KMT2AALDH1A1KDM4E | |
| SCHEMBL2258718 | 0.85 | TSHR (0.59) | TSHRMEN1KMT2AHSP90AA1HSP90AB1 | |
| SCHEMBL10489460 | 0.85 | TSHR (0.59) | TSHRMEN1KMT2AHSP90AA1HSP90AB1 | |
| SCHEMBL8094585 | 0.84 | TSHR (0.40) | TSHRMEN1KMT2AALDH1A1 | |
| SCHEMBL8095892 | 0.83 | MEN1 (0.39) | TSHRMEN1KMT2AALDH1A1KDM4E | |
| SCHEMBL21961149 | 0.83 | TSHR (0.57) | TSHRMEN1KMT2AALDH1A1PPARA | |
| SCHEMBL1904536 | 0.83 | TSHR (0.57) | TSHRMEN1KMT2AALDH1A1PPARA | |
| SCHEMBL14216632 | 0.83 | TSHR (0.57) | TSHRMEN1KMT2AHSP90AA1HSP90AB1 | |
| SCHEMBL8087566 | 0.83 | ALDH1A1 (0.43) | TSHRMEN1KMT2AALDH1A1PPARA | |
| SCHEMBL8094200 | 0.82 | GABRA1 (0.48) | TSHRKMT2AALDH1A1GABRA1GABRB2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0708077-B1 | Diamino compounds and methods for preparing them | CHISSO CORP (JP) | 2000-12-27 | — | — | EP | disclosed |
| US-5663440-A | Diamino compounds and methods for preparing them | CHISSO CORPORATION (JP) | 1997-09-02 | — | — | US | disclosed |
| EP-0708077-A1 | Diamino compounds and methods for preparing them | CHISSO CORPORATION (JP) | 1996-04-24 | — | — | EP | disclosed |